N-[2-(2-methyl-1-oxidanyl-propan-2-yl)-6-nitro-1,2,3,4-tetrahydroquinolin-4-yl]propanamide

Systemtic Name: N-[2-(2-methyl-1-oxidanyl-propan-2-yl)-6-nitro-1,2,3,4-tetrahydroquinolin-4-yl]propanamide Openeye Name: N-[2-(2-hydroxy-1,1-dimethyl-ethyl)-6-nitro-1,2,3,4-tetrahydroquinolin-4-yl]propanamide CAS Name: N-[2-(1-hydroxy-2-methylpropan-2-yl)-6-nitro-1,2,3,4-tetrahydroquinolin-4-yl]propanamide IUPAC Name: N-[2-(1-hydroxy-2-methylpropan-2-yl)-6-nitro-1,2,3,4-tetrahydroquinolin-4-yl]propanamide Traditional Name: N-[2-(2-hydroxy-1,1-dimethyl-ethyl)-6-nitro-1,2,3,4-tetrahydroquinolin-4-yl]propionamide Formula: C16H23N3O4 MolecularWeight: 321.37152

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1CC(NC2=C1C=C(C=C2)[N+](=O)[O-])C(C)(C)CO

Isomeric SMILES

CCC(=O)NC1CC(NC2=C1C=C(C=C2)[N+](=O)[O-])C(C)(C)CO

InChI

InChI=1S/C16H23N3O4/c1-4-15(21)18-13-8-14(16(2,3)9-20)17-12-6-5-10(19(22)23)7-11(12)13/h5-7,13-14,17,20H,4,8-9H2,1-3H3,(H,18,21)